ethyl 2-[4-(4-ethenylpyrazol-1-yl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[4-(4-ethenylpyrazol-1-yl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[4-(4-vinylpyrazol-1-yl)pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[4-(4-ethenyl-1-pyrazolyl)-2-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-ethenylpyrazol-1-yl)pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-(4-vinylpyrazol-1-yl)pyrimidin-2-yl]thio]acetic acid ethyl ester Formula: C13H14N4O2S MolecularWeight: 290.34086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=CC(=N1)N2C=C(C=N2)C=C

Isomeric SMILES

CCOC(=O)CSC1=NC=CC(=N1)N2C=C(C=N2)C=C

InChI

InChI=1S/C13H14N4O2S/c1-3-10-7-15-17(8-10)11-5-6-14-13(16-11)20-9-12(18)19-4-2/h3,5-8H,1,4,9H2,2H3